SCHEMBL6899424

SCHEMBL6899424

CCO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 7/20 0.56
LMNA P02545 2/20 0.56
SLC29A1 Q99808 2/20 0.56
NFKB1 P19838 2/20 0.56
THPO P40225 2/20 0.56
ALDH1A1 P00352 1/20 0.56
GLA P06280 1/20 0.56
PMP22 Q01453 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPC1 O15118 1/20 0.56
NPY1R P25929 1/20 0.56
HTT P42858 1/20 0.56
NPY2R P49146 1/20 0.56
RAB9A P51151 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
CYP1A2 P05177 1/20 0.56
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
CYP2C19 P33261 1/20 0.56
ADORA3 P0DMS8 4/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6899430 1.00 ADORA1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL6897956 0.94 ADORA1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL6898740 0.93 ADORA1 (0.55) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL19407591 0.92 ADORA1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL7064875 0.92 ADORA1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL38653713 0.92 ADORA1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL7064871 0.92 ADORA1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL6896950 0.92 SLC29A1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL9006338 0.92 SLC29A1 (0.56) ADORA1LMNASLC29A1NFKB1THPO
SCHEMBL19841206 0.91 MEN1 (0.63) ADORA1LMNASLC29A1NFKB1THPO

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1418179-A2 Compositions and methods for detecting and modulating rna activity and gene expression ISIS PHARMACEUTICALS, INC. (US) 2004-05-12 EP disclosed
EP-0604409-A4 COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION. ISIS PHARMACEUTICALS INC (US) 1996-06-12 EP disclosed
EP-0604409-A1 COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 1994-07-06 EP disclosed
WO-1991010671-A1 COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 1991-07-25 WO disclosed